EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70995 - trans-13-methyltetradec-2-enal

ChEBI IDCHEBI:70995
ChEBI Nametrans-13-methyltetradec-2-enal
Stars
ASCII Nametrans-13-methyltetradec-2-enal
DefinitionAn enal consisting of tetradec-2-enal substituted at position 13 by a methyl group.
Last Modified24 April 2018
SubmitterAnneNiknejad
DownloadsMolfile
FormulaC15H28O
Net Charge0
Average Mass224.388
Monoisotopic Mass224.21402
SMILES[H]C(=O)/C=C/CCCCCCCCCC(C)C
InChIInChI=1S/C15H28O/c1-15(2)13-11-9-7-5-3-4-6-8-10-12-14-16/h10,12,14-15H,3-9,11,13H2,1-2H3/b12-10+
InChIKeyXCQVBFWYULNOQE-ZRDIBKRKSA-N
ChEBI Ontology
Outgoing Relation(s)
trans-13-methyltetradec-2-enal (CHEBI:70995) is a 13-methyltetradecenal (CHEBI:140521)
trans-13-methyltetradec-2-enal (CHEBI:70995) is a enal (CHEBI:51688)
trans-13-methyltetradec-2-enal (CHEBI:70995) is a monounsaturated fatty aldehyde (CHEBI:61870)
IUPAC Name 
(2E)-13-methyltetradec-2-enal
Synonyms  Source
(E)-13-methyltetradec-2-enalChEBI
(E)-isopentadec-2-enalChEBI
trans-isopentadec-2-enalChEBI
UniProt Name  Source
(2E)-13-methyltetradecenalUniProt
Registry NumbersSources
Reaxys:8687945Reaxys